N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide

C14H14FNO2 — CID 110443410

IUPACN-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide
SMILESCC(C)(NC(=O)c1ccco1)c1ccccc1F
InChIInChI=1S/C14H14FNO2/c1-14(2,10-6-3-4-7-11(10)15)16-13(17)12-8-5-9-18-12/h3-9H,1-2H3,(H,16,17)
InChIKeyYUUZYBUQOBTEQM-UHFFFAOYSA-N
MW247.27 g/mol
LogP3.08
Rot. Bonds3

About N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide

N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide (PubChem CID 110443410) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide
PubChem CID110443410
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC NameN-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide
SMILESCC(C)(NC(=O)c1ccco1)c1ccccc1F
InChIInChI=1S/C14H14FNO2/c1-14(2,10-6-3-4-7-11(10)15)16-13(17)12-8-5-9-18-12/h3-9H,1-2H3,(H,16,17)
InChIKeyYUUZYBUQOBTEQM-UHFFFAOYSA-N
XLogP3.08
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide (CID 110443410) is N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide is CC(C)(NC(=O)c1ccco1)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide?
The InChIKey is YUUZYBUQOBTEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO2/c1-14(2,10-6-3-4-7-11(10)15)16-13(17)12-8-5-9-18-12/h3-9H,1-2H3,(H,16,17).
What are the key properties of N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide?
N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide has a molecular weight of 247.27 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 110443410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).